[2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine

C11H18N4S — CID 83201594

IUPAC[2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
SMILESCC(C)CCc1nc2c(c(NN)n1)CSC2
InChIInChI=1S/C11H18N4S/c1-7(2)3-4-10-13-9-6-16-5-8(9)11(14-10)15-12/h7H,3-6,12H2,1-2H3,(H,13,14,15)
InChIKeyPUVBVEFNGXNAPJ-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.10
Rot. Bonds4

About [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine

[2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine (PubChem CID 83201594) has the molecular formula C11H18N4S and a molecular weight of 238.36 g/mol. Its IUPAC name is [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
PubChem CID83201594
Molecular FormulaC11H18N4S
Molecular Weight238.36 g/mol
Exact Mass238.13
IUPAC Name[2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
SMILESCC(C)CCc1nc2c(c(NN)n1)CSC2
InChIInChI=1S/C11H18N4S/c1-7(2)3-4-10-13-9-6-16-5-8(9)11(14-10)15-12/h7H,3-6,12H2,1-2H3,(H,13,14,15)
InChIKeyPUVBVEFNGXNAPJ-UHFFFAOYSA-N
XLogP2.10
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83191076
[2-(propan-2-ylsulfanylmethyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83200520
4-chloro-2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidine
CID 83196343
(2-propan-2-yl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl)hydrazine
CID 83200451
[2-(1-methoxypropan-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 116503122
[5,6-dimethyl-2-(3-methylbutyl)pyrimidin-4-yl]hydrazine
CID 62250159
[2-[(2-methoxyphenyl)methyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83201588
[2-(phenylsulfanylmethyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83200763
[2-(thiophen-2-ylmethyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83201587
[3-(3-methylbutyl)-1,2,4-oxadiazol-5-yl]hydrazine
CID 62596699
2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 105482392
[2-(4-propylcyclohexyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83200676

Frequently Asked Questions

What is the IUPAC name of [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine (CID 83201594) is [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine is CC(C)CCc1nc2c(c(NN)n1)CSC2.
What is the InChIKey of [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
The InChIKey is PUVBVEFNGXNAPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4S/c1-7(2)3-4-10-13-9-6-16-5-8(9)11(14-10)15-12/h7H,3-6,12H2,1-2H3,(H,13,14,15).
What are the key properties of [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
[2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine has a molecular weight of 238.36 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methylbutyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 83201594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).